Chemical Properties of 3-Phenylpropanoic anhydride

3-Phenylpropanoic anhydride

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InChI
InChI=1S/C18H18O3/c19-17(13-11-15-7-3-1-4-8-15)21-18(20)14-12-16-9-5-2-6-10-16/h1-10H,11-14H2
InChI Key
SQAHPYZABTWPNY-UHFFFAOYSA-N
Formula
C18H18O3
SMILES
O=C(CCc1ccccc1)OC(=O)CCc1ccccc1
Molecular Weight1
282.33
Sources

Physical Properties

Property Value Unit Source
Δf -37.34 kJ/mol Joback Calculated Property
Δfgas -299.17 kJ/mol Joback Calculated Property
Δfus 34.84 kJ/mol Joback Calculated Property
Δvap 76.12 kJ/mol Joback Calculated Property
logPoct/wat 3.32 Crippen Calculated Property
Pc 2113.89 kPa Joback Calculated Property
Tboil 794.76 K Joback Calculated Property
Tc 1024.98 K Joback Calculated Property
Tfus 467.55 K Joback Calculated Property
Vc 0.86 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 642.62 J/mol×K 794.76 Joback Calculated Property
η 0.00 Pa×s 794.76 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
=C< (ring) 2
-CH2- 4
>C=O (nonring) 2
=CH- (ring) 10

Similar Compounds

Benzenepropanoic acid, 3-phenylpropyl ester. Benzenepropanoic acid, ethyl ester. Benzenepropanoic acid, pentyl ester. Benzenepropanol, propanoate. 3-Phenylpropionic acid, 3-methylbutyl ester. Benzenepropanoic acid, hexyl ester. Benzenepropanoic acid 1-methylethyl ester. 3-Phenylpropanoic acid methyl ester. (Z)-Hex-3-enyl dihydrocinnamate. 3-Phenylpropionic acid, 2-methylbutyl ester. Butanoic acid, 3-phenylpropyl ester. Propanoic acid, 2-methyl-, 3-phenylpropyl ester. 3-Phenyl-1-propanol, acetate. 3-Phenylpropionic acid, 8-chlorooctyl ester. 3-Phenylpropionic acid, 3-methylbut-2-yl ester.

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